Geometry & MOs

Info

ID:	339516
PubChem CID:	127261506
Reduced:	N9O9C19H31 (1)
Stoich.:	A9B9C19D31 (1)
Weight, g/mol:	392.242356
ΔH_f, kcal/mol:	-401.51
Dipole, Da:	10.55
IP(EA), eV:	-9.93(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-amino-N-[(2R)-1-[(2-amino-2-oxoethyl)-(4-methylpentan-2-yl)amino]-1-oxopropan-2-yl]-3-(4-hydroxyphenyl)propanamide

Drug info:

PubChemData

Smile

CC(=O)NCC(=O)NCC(=O)NCC(=O)NCC(=O)NCC(=O)NCC(=O)NCC(=O)N(C)CC(=O)N

DOS

IR

Vibrations